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#542 MOPAC 2012 output file not accepted as input

closed-fixed
5
2012-12-21
2012-12-18
No

The attached MOPAC 2012 calculation is not read in by Jmol. The error message displayed is:
unrecognized file format for <filename>
******************************************************************************
**Site#: 3277 For non-commercial use only Version 12.309W**
******************************************************************************

Discussion

  • Michael Kausch

    Michael Kausch - 2012-12-18

    Sample file

     
  • Bob Hanson

    Bob Hanson - 2012-12-18

    fixed for Jmol 13.0.11 and 13.1.11 for all MOPAC files through year 2999. When that time comes, we can ask Jimmy Stewart (Mr. MOPAC) if he's still interested in using Jmol. :)

    See http://chemapps.stolaf.edu/jmol/Jmol-13.zip

     
  • Bob Hanson

    Bob Hanson - 2012-12-21
    • status: open --> closed-fixed
     
  • Michael Kausch

    Michael Kausch - 2013-02-18

    Bug is back in Jmol 13.0.12

     
  • Bob Hanson

    Bob Hanson - 2013-02-18

    ah, yes! Thank you. I have checked in that change in 13.0 and marked 13.0.13 for release.

     

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